2-Nitrodibenzothiophene

Base Information

Chemical Name:2-Nitrodibenzothiophene
CAS No.:6639-36-7
Molecular Formula:C12H7 N O2 S
Molecular Weight:229.259
Hs Code.:2934999090
European Community (EC) Number:622-552-7
NSC Number:16062
UNII:EK8F3V9FW3
DSSTox Substance ID:DTXSID00216609
Nikkaji Number:J364.307G
Wikidata:Q72494620
Mol file:6639-36-7.mol

Synonyms:2-Nitrodibenzothiophene;2-Nitrodibenzo[b,d]thiophene;6639-36-7;Dibenzothiophene, 2-nitro-;EK8F3V9FW3;CCRIS 8629;NSC-16062;2-NITRODIBENZO(B,D)THIOPHENE;NSC16062;UNII-EK8F3V9FW3;SCHEMBL5115377;2-Nitrodibenzo[b,d]thiophene #;DTXSID00216609;C12-H7-N-O-2S;MFCD00092341;NSC 16062;AKOS016010417;LS-61509;FT-0636219;A867468;AO-436/00494004

Suppliers and Price of 2-Nitrodibenzothiophene

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Usbiological
2-Nitrodibenzothiophene
500mg
$ 468.00

TRC
2-Nitrodibenzothiophene
1g
$ 165.00

Medical Isotopes, Inc.
2-Nitrodibenzothiophene
10 g
$ 2200.00

Medical Isotopes, Inc.
2-Nitrodibenzothiophene
1 g
$ 650.00

Crysdot
2-Nitrodibenzo[b,d]thiophene 95+%
5g
$ 450.00

Crysdot
2-Nitrodibenzo[b,d]thiophene 95+%
1g
$ 150.00

Chemenu
2-Nitrodibenzo[b,d]thiophene 95%+
250mg
$ 136.00

Chemenu
2-Nitrodibenzo[b,d]thiophene 95%+
100mg
$ 70.00

Chemenu
2-Nitrodibenzo[b,d]thiophene 95%+
10g
$ 1463.00

Chemenu
2-Nitrodibenzo[b,d]thiophene 95%+
5g
$ 876.00

Total 37 raw suppliers

Chemical Property of 2-Nitrodibenzothiophene

Chemical Property:

Vapor Pressure:5.88E-07mmHg at 25°C
Melting Point:186℃
Boiling Point:423℃
Flash Point:209℃
PSA：74.06000
Density:1.441
LogP:4.48590
Storage Temp.:Keep in dark place,Sealed in dry,Room Temperature
XLogP3:4.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:0
Exact Mass:229.01974964
Heavy Atom Count:16
Complexity:291

Purity/Quality:

97% ^*data from raw suppliers

2-Nitrodibenzothiophene ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)[N+](=O)[O-]
Uses 2-Nitrodibenzothiophene is a nitrated polycyclic aromatic hydrocarbon (PAH). 2-Nitrodibenzothiophene is removed from coal by hydrogenation in Tetralin.

Technology Process of 2-Nitrodibenzothiophene

There total 15 articles about 2-Nitrodibenzothiophene which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 75.0%

: 6320-02-1
o-bromothiophenol

: 586-78-7
para-nitrophenyl bromide

: 6639-36-7
2-nitro-dibenzothiophene

Guidance literature:: With dichloro bis(acetonitrile) palladium(II); cesium pivalate; bis[2-(diphenylphosphino)phenyl] ether; In N,N-dimethyl acetamide; at 140 ℃; for 24h; Schlenk technique; Inert atmosphere; Sealed tube;
DOI:10.1039/c8ob00235e

Reference yield: 67.0%

: 132-65-0
dibenzothiophene

: 6639-36-7
2-nitro-dibenzothiophene

Guidance literature:: With nitric acid; acetic acid; at 60 ℃; for 3h;

Reference yield: 40.0%

: 636-98-6
p-nitrobenzene iodide

: 6320-02-1
o-bromothiophenol

: 6639-36-7
2-nitro-dibenzothiophene

Guidance literature:: With dichloro bis(acetonitrile) palladium(II); cesium pivalate; bis[2-(diphenylphosphino)phenyl] ether; In N,N-dimethyl acetamide; at 140 ℃; for 24h; Schlenk technique; Inert atmosphere; Sealed tube;
DOI:10.1039/c8ob00235e